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DL-3-Aminoisobutyric acid: vibrational, NBO and AIM analysis of N–H⋯O bonded-zwitterionic dimer model

A zwitterionic dimer model constructed of inter-molecular –N–H⋯O bonding has been proposed for the solid sample of DL-3-Aminoisobutyric acid consistent with IR absorption and Raman spectral features measured in the 3500–400/50 cm(−1). This zwitterionic dimer model in water as solvent has been comput...

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Detalles Bibliográficos
Autores principales: Yalagi, Shashikala, Tonannavar, Jagdish, Tonannavar, Jayashree
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6587070/
https://www.ncbi.nlm.nih.gov/pubmed/31286081
http://dx.doi.org/10.1016/j.heliyon.2019.e01933